5-(4-ethoxy-3-methoxyphenyl)-1H-pyrazol-3-amine

C12H15N3O2 — CID 3480116

IUPAC5-(4-ethoxy-3-methoxyphenyl)-1H-pyrazol-3-amine
SMILESCCOc1ccc(-c2cc(N)n[nH]2)cc1OC
InChIInChI=1S/C12H15N3O2/c1-3-17-10-5-4-8(6-11(10)16-2)9-7-12(13)15-14-9/h4-7H,3H2,1-2H3,(H3,13,14,15)
InChIKeyQNHAPHXEYAKWDD-UHFFFAOYSA-N
MW233.27 g/mol
LogP2.07
Rot. Bonds4

About 5-(4-ethoxy-3-methoxyphenyl)-1H-pyrazol-3-amine

5-(4-ethoxy-3-methoxyphenyl)-1H-pyrazol-3-amine (PubChem CID 3480116) has the molecular formula C12H15N3O2 and a molecular weight of 233.27 g/mol. Its IUPAC name is 5-(4-ethoxy-3-methoxyphenyl)-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-(4-ethoxy-3-methoxyphenyl)-1H-pyrazol-3-amine
PubChem CID3480116
Molecular FormulaC12H15N3O2
Molecular Weight233.27 g/mol
Exact Mass233.12
IUPAC Name5-(4-ethoxy-3-methoxyphenyl)-1H-pyrazol-3-amine
SMILESCCOc1ccc(-c2cc(N)n[nH]2)cc1OC
InChIInChI=1S/C12H15N3O2/c1-3-17-10-5-4-8(6-11(10)16-2)9-7-12(13)15-14-9/h4-7H,3H2,1-2H3,(H3,13,14,15)
InChIKeyQNHAPHXEYAKWDD-UHFFFAOYSA-N
XLogP2.07
TPSA73.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-(4-ethoxy-3-methoxyphenyl)-1H-pyrazol-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-(3-bromo-4-methoxyphenyl)-1H-pyrazol-3-amine
CID 3614347
5-(3-amino-1H-pyrazol-5-yl)-2-methoxyphenol
CID 130019057
5-[4-methoxy-3-(methoxymethyl)phenyl]-1H-pyrazol-3-amine
CID 117338097
N-[5-(3-amino-1H-pyrazol-5-yl)-2-ethoxyphenyl]acetamide
CID 82484529
5-(4-ethoxy-3-methoxyphenyl)-4-iodo-1H-pyrazol-3-amine
CID 4203083
5-(4-ethoxynaphthalen-1-yl)-1H-pyrazol-3-amine
CID 3539207
5-[3-methoxy-4-(thiolan-3-yloxy)phenyl]-1H-pyrazol-3-amine
CID 117470678
5-(3,4-dimethoxyphenyl)-N-methyl-1H-pyrazol-3-amine
CID 63047414
5-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]-1H-pyrazol-3-amine
CID 117465926
2,5-bis(4-ethoxy-3-methoxyphenyl)-3,4-dimethylfuran
CID 11069311
3-[(4-ethoxy-3-methoxyphenyl)methoxy]-1H-pyrazol-5-amine
CID 68878550
5-[3,4-dimethoxy-5-(methoxymethyl)phenyl]-1H-pyrazol-3-amine
CID 117412509

Frequently Asked Questions

What is the IUPAC name of 5-(4-ethoxy-3-methoxyphenyl)-1H-pyrazol-3-amine?
The IUPAC name of 5-(4-ethoxy-3-methoxyphenyl)-1H-pyrazol-3-amine (CID 3480116) is 5-(4-ethoxy-3-methoxyphenyl)-1H-pyrazol-3-amine.
What is the SMILES notation for 5-(4-ethoxy-3-methoxyphenyl)-1H-pyrazol-3-amine?
The canonical SMILES for 5-(4-ethoxy-3-methoxyphenyl)-1H-pyrazol-3-amine is CCOc1ccc(-c2cc(N)n[nH]2)cc1OC.
What is the InChIKey of 5-(4-ethoxy-3-methoxyphenyl)-1H-pyrazol-3-amine?
The InChIKey is QNHAPHXEYAKWDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O2/c1-3-17-10-5-4-8(6-11(10)16-2)9-7-12(13)15-14-9/h4-7H,3H2,1-2H3,(H3,13,14,15).
What are the key properties of 5-(4-ethoxy-3-methoxyphenyl)-1H-pyrazol-3-amine?
5-(4-ethoxy-3-methoxyphenyl)-1H-pyrazol-3-amine has a molecular weight of 233.27 g/mol, XLogP of 2.07, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-ethoxy-3-methoxyphenyl)-1H-pyrazol-3-amine is sourced from PubChem (CID 3480116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).